SCHEMBL10587167

SCHEMBL10587167

Cc1ccc(S(N)(=O)=O)c(Cc2ccccc2)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.42
CA1 P00915 5/20 0.42
CA9 Q16790 4/20 0.42
CA12 O43570 3/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5A P35218 1/20 0.39
STS P08842 1/20 0.39
ALDH1A1 P00352 2/20 0.39
IDH1 O75874 1/20 0.39
PTGES2 Q9H7Z7 2/20 0.38
MAOB P27338 1/20 0.38
CA6 P23280 1/20 0.38
CA7 P43166 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
SHBG P04278 1/20 0.37
PDIA6 Q15084 1/20 0.36
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30988960 0.84 CA1 (0.41) CA2CA1CA9CA12CA14
SCHEMBL30988958 0.84 CA1 (0.41) CA2CA1CA9CA12CA14
SCHEMBL30988957 0.84 CA1 (0.41) CA2CA1CA9CA12CA14
SCHEMBL28420913 0.81 ALDH1A1 (0.39) STSALDH1A1IDH1MAPTHPGD
SCHEMBL4566034 0.81 ALDH1A1 (0.44) CA2CA1CA9CA12CA14
SCHEMBL7520955 0.77 CA2 (0.46) CA2CA1CA9CA12CA14
SCHEMBL9066733 0.77 IDH1 (0.49) ALDH1A1IDH1SHBGMAPTHPGD
SCHEMBL31345536 0.77 IDH1 (0.49) ALDH1A1IDH1SHBGMAPTHPGD
SCHEMBL3837671 0.74 CA1 (0.42) CA2CA1CA9CA12CA14
SCHEMBL29988453 0.74 CA1 (0.51) CA2CA1CA9CA12CA14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326170-A1 Sulfonamide and herbicide containing the same as active ingredient MITSUBISHI KASEI CORPORATION (JP) 1989-08-02 EP disclosed